N-[[4-(3-cyanophenyl)sulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-(4-methylphenyl)ethanamide

Systemtic Name: N-[[4-(3-cyanophenyl)sulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-(4-methylphenyl)ethanamide Openeye Name: N-[[4-(3-cyanophenyl)sulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-(p-tolyl)acetamide CAS Name: N-[[4-(3-cyanophenyl)sulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-(4-methylphenyl)acetamide IUPAC Name: N-[[4-(3-cyanophenyl)sulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-(4-methylphenyl)acetamide Traditional Name: N-[[4-(3-cyanophenyl)sulfonyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-(p-tolyl)acetamide Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC2=CC3=C(C=C2)OCCN(C3)S(=O)(=O)C4=CC=CC(=C4)C#N)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CC2=CC3=C(C=C2)OCCN(C3)S(=O)(=O)C4=CC=CC(=C4)C#N)C(=O)C

InChI

InChI=1S/C26H25N3O4S/c1-19-6-9-24(10-7-19)29(20(2)30)17-22-8-11-26-23(14-22)18-28(12-13-33-26)34(31,32)25-5-3-4-21(15-25)16-27/h3-11,14-15H,12-13,17-18H2,1-2H3